SCHEMBL11259613

SCHEMBL11259613

CN(C)CCCCOc1ccccc1CCc1ccc(Cl)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.49
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HTR1B P28222 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
KDM4E B2RXH2 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11255685 0.92 DRD2 (0.52) HRH1SLC6A2SLC6A4SLC6A3HTR1B
SCHEMBL11264682 0.88 TAAR1 (0.58) HRH1HTR1BHRH3KDM4E
Hydrochloric Acid SCHEMBL11258745 0.87 TAAR1 (0.57) HRH1HTR1BHRH3KDM4E
SCHEMBL11269198 0.87 TAAR1 (0.57) HRH1HTR1BHRH3KDM4E
SCHEMBL11259238 0.84 HRH1 (0.55) HRH1HTR1B
SCHEMBL11250748 0.84 HRH1 (0.60) HRH1HTR1BHRH3
SCHEMBL11256434 0.83 HRH1 (0.53) HRH1HTR1B
SCHEMBL11260485 0.80 HRH1 (0.59) HRH1
SCHEMBL11254742 0.80 HRH1 (0.59) HRH1
SCHEMBL11262970 0.79 HRH1 (0.57) HRH1HTR1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323568-A INHIBIT PLATELET AGGREGATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1982-04-06 US disclosed
EP-0001759-B1 (OMEGA-AMINOALKOXY) BIBENZYLS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE SUBSTANCES MITSUBISHI KASEI CORPORATION (JP) 1981-12-30 EP disclosed
US-4220603-A ANTICOAGULANTS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1980-09-02 US disclosed